3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol

C9H11N3O2 — CID 130992331

IUPAC3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol
SMILESOCCCNc1nncc2ccoc12
InChIInChI=1S/C9H11N3O2/c13-4-1-3-10-9-8-7(2-5-14-8)6-11-12-9/h2,5-6,13H,1,3-4H2,(H,10,12)
InChIKeyKPASSVPNEBYFSH-UHFFFAOYSA-N
MW193.21 g/mol
LogP1.02
Rot. Bonds4

About 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol

3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol (PubChem CID 130992331) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol.

Molecular Properties

Compound Name3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol
PubChem CID130992331
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol
SMILESOCCCNc1nncc2ccoc12
InChIInChI=1S/C9H11N3O2/c13-4-1-3-10-9-8-7(2-5-14-8)6-11-12-9/h2,5-6,13H,1,3-4H2,(H,10,12)
InChIKeyKPASSVPNEBYFSH-UHFFFAOYSA-N
XLogP1.02
TPSA71.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)furo[2,3-d]pyridazin-7-amine
CID 131175686
N-(2-chloroprop-2-enyl)furo[2,3-d]pyridazin-7-amine
CID 130611757
2-(phthalazin-1-ylamino)ethanol
CID 2065587
N-[[1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]furo[2,3-d]pyridazin-7-amine
CID 126919411
3-[(3-chloro-1,2,4-triazin-5-yl)amino]propan-1-ol
CID 114998205
3-[(3-amino-6-chloro-2-pyridinyl)amino]propan-1-ol
CID 115473663
3-[(3,6-dichloro-1,2,4-triazin-5-yl)amino]propan-1-ol
CID 81038146
3-[(8-chloro-2-phenylpyrimido[4,5-d]pyridazin-5-yl)amino]propan-1-ol
CID 23256697
3-[[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]propan-1-ol
CID 3569216
methyl 6-(phthalazin-1-ylamino)hexanoate
CID 60631363
3-[(5-iodopyrimidin-4-yl)amino]propan-1-ol
CID 66340103
3-[[3-(hydroxymethyl)-2-pyridinyl]amino]propan-1-ol
CID 82341835

Frequently Asked Questions

What is the IUPAC name of 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol?
The IUPAC name of 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol (CID 130992331) is 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol.
What is the SMILES notation for 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol?
The canonical SMILES for 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol is OCCCNc1nncc2ccoc12.
What is the InChIKey of 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol?
The InChIKey is KPASSVPNEBYFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c13-4-1-3-10-9-8-7(2-5-14-8)6-11-12-9/h2,5-6,13H,1,3-4H2,(H,10,12).
What are the key properties of 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol?
3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol has a molecular weight of 193.21 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furo[2,3-d]pyridazin-7-ylamino)propan-1-ol is sourced from PubChem (CID 130992331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).